CID 12801435

2253620-90-3

Structural Information

Molecular Formula
C7H15NO
SMILES
CCC([C@@H]1CCCN1)O
InChI
InChI=1S/C7H15NO/c1-2-7(9)6-4-3-5-8-6/h6-9H,2-5H2,1H3/t6-,7?/m0/s1
InChIKey
LFTVAAQLOUXONP-PKPIPKONSA-N
Compound name
1-[(2S)-pyrrolidin-2-yl]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

129.11537 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 131.0
[M+Na]+ 152.104588 135.9
[M-H]- 128.108094 129.7
[M+NH4]+ 147.149193 151.8
[M+K]+ 168.078528 134.3
[M+H-H2O]+ 112.112630 125.3
[M+HCOO]- 174.113571 148.8
[M+CH3COO]- 188.129221 166.3
[M+Na-2H]- 150.090036 133.5
[M]+ 129.11482142 125.4
[M]- 129.11591858 125.4
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

patents stripe