CID 12628016

Phenyl(pyrrolidin-2-yl)methanol

Structural Information

Molecular Formula
C11H15NO
SMILES
C1CC(NC1)C(C2=CC=CC=C2)O
InChI
InChI=1S/C11H15NO/c13-11(10-7-4-8-12-10)9-5-2-1-3-6-9/h1-3,5-6,10-13H,4,7-8H2
InChIKey
YPMHBZQROFTOSU-UHFFFAOYSA-N
Compound name
phenyl(pyrrolidin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

62
Patents

177.11537 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.12265 140.2
[M+Na]+ 200.10459 144.8
[M-H]- 176.10809 142.1
[M+NH4]+ 195.14919 158.7
[M+K]+ 216.07853 141.3
[M+H-H2O]+ 160.11263 133.3
[M+HCOO]- 222.11357 158.4
[M+CH3COO]- 236.12922 173.9
[M+Na-2H]- 198.09004 143.1
[M]+ 177.11482 133.7
[M]- 177.11592 133.7
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