CID 71757782

3-(2-methylpyrrolidin-2-yl)propan-1-ol

Structural Information

Molecular Formula
C8H17NO
SMILES
CC1(CCCN1)CCCO
InChI
InChI=1S/C8H17NO/c1-8(5-3-7-10)4-2-6-9-8/h9-10H,2-7H2,1H3
InChIKey
URVMAVWYKUWGMW-UHFFFAOYSA-N
Compound name
3-(2-methylpyrrolidin-2-yl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.13101 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.138286 134.1
[M+Na]+ 166.120228 139.8
[M-H]- 142.123734 132.9
[M+NH4]+ 161.164833 156.5
[M+K]+ 182.094168 137.6
[M+H-H2O]+ 126.128270 129.1
[M+HCOO]- 188.129211 152.6
[M+CH3COO]- 202.144861 168.1
[M+Na-2H]- 164.105676 138.5
[M]+ 143.13046142 129.8
[M]- 143.13155858 129.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.