Metabolite Pindolol Sulfate

Name

Pindolol Sulfate

Description

Not Available

Structure

Similar Structures

Synonyms

Not Available

UNII

Not Available

CAS number

Not Available

Weight

Average: 264.325
Monoisotopic: 264.147392512

Chemical Formula

C₁₄H₂₀N₂O₃

InChI Key

OYMQPTQZROCVGR-UHFFFAOYSA-N

InChI

InChI=1S/C14H20N2O3/c1-10(2)16(18)8-11(17)9-19-14-5-3-4-13-12(14)6-7-15-13/h3-7,10-11,15,17-18H,8-9H2,1-2H3

IUPAC Name

1-[N-hydroxy-N-(propan-2-yl)amino]-3-(1H-indol-4-yloxy)propan-2-ol

SMILES

CC(C)N(O)CC(O)COC1=CC=CC2=C1C=CN2

Reactions

Spectra

Spectrum	Spectrum Type	Splash Key
Predicted MS/MS Spectrum - 10V, Positive (Annotated)	Predicted LC-MS/MS	splash10-014i-0090000000-46e60d94c5dc49660c59
Predicted MS/MS Spectrum - 10V, Negative (Annotated)	Predicted LC-MS/MS	splash10-06si-6930000000-116e51e8b9360235fb05
Predicted MS/MS Spectrum - 20V, Positive (Annotated)	Predicted LC-MS/MS	splash10-06vj-0590000000-8f9156964ee202232dba
Predicted MS/MS Spectrum - 20V, Negative (Annotated)	Predicted LC-MS/MS	splash10-001i-2910000000-9d6a29728d6caa0bf032
Predicted MS/MS Spectrum - 40V, Negative (Annotated)	Predicted LC-MS/MS	splash10-001i-1900000000-d806db120f50df80c441
Predicted MS/MS Spectrum - 40V, Positive (Annotated)	Predicted LC-MS/MS	splash10-02aj-3900000000-e629afc11c2b01ee2852

Chromatographic Properties

Adduct	CCS Value (Å²)	Source type	Source
[M-H]-	156.53543	predicted	DeepCCS 1.0 (2019)
[M-H]-	156.53543	predicted	DeepCCS 1.0 (2019)
[M-H]-	156.53543	predicted	DeepCCS 1.0 (2019)
[M-H]-	156.53543	predicted	DeepCCS 1.0 (2019)
[M-H]-	156.53543	predicted	DeepCCS 1.0 (2019)
[M-H]-	156.53543	predicted	DeepCCS 1.0 (2019)
[M-H]-	156.53543	predicted	DeepCCS 1.0 (2019)
[M-H]-	156.53543	predicted	DeepCCS 1.0 (2019)
[M+H]+	158.89343	predicted	DeepCCS 1.0 (2019)
[M+H]+	158.89343	predicted	DeepCCS 1.0 (2019)
[M+H]+	158.89343	predicted	DeepCCS 1.0 (2019)
[M+H]+	158.89343	predicted	DeepCCS 1.0 (2019)
[M+H]+	158.89343	predicted	DeepCCS 1.0 (2019)
[M+H]+	158.89343	predicted	DeepCCS 1.0 (2019)
[M+H]+	158.89343	predicted	DeepCCS 1.0 (2019)
[M+H]+	158.89343	predicted	DeepCCS 1.0 (2019)
[M+Na]+	164.98659	predicted	DeepCCS 1.0 (2019)
[M+Na]+	164.98659	predicted	DeepCCS 1.0 (2019)
[M+Na]+	164.98659	predicted	DeepCCS 1.0 (2019)
[M+Na]+	164.98659	predicted	DeepCCS 1.0 (2019)
[M+Na]+	164.98659	predicted	DeepCCS 1.0 (2019)
[M+Na]+	164.98659	predicted	DeepCCS 1.0 (2019)
[M+Na]+	164.98659	predicted	DeepCCS 1.0 (2019)
[M+Na]+	164.98659	predicted	DeepCCS 1.0 (2019)

External Links

Not Available

Predicted Properties