CID 23383549

(1-propylpyrrolidin-2-yl)methanol

Structural Information

Molecular Formula
C8H17NO
SMILES
CCCN1CCCC1CO
InChI
InChI=1S/C8H17NO/c1-2-5-9-6-3-4-8(9)7-10/h8,10H,2-7H2,1H3
InChIKey
GDIQPZRESMPKNH-UHFFFAOYSA-N
Compound name
(1-propylpyrrolidin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

143.13101 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.138286 133.7
[M+Na]+ 166.120228 139.8
[M-H]- 142.123734 133.9
[M+NH4]+ 161.164833 155.1
[M+K]+ 182.094168 138.4
[M+H-H2O]+ 126.128270 127.8
[M+HCOO]- 188.129211 153.7
[M+CH3COO]- 202.144861 172.3
[M+Na-2H]- 164.105676 136.8
[M]+ 143.13046142 131.4
[M]- 143.13155858 131.4
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