CID 15632194

13830-40-5

Structural Information

Molecular Formula
C9H10O
SMILES
C1[C@H]([C@@H]1O)C2=CC=CC=C2
InChI
InChI=1S/C9H10O/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-10H,6H2/t8-,9+/m0/s1
InChIKey
ALZCLGLXXXRKLE-DTWKUNHWSA-N
Compound name
trans-(1R,2S)-2-phenylcyclopropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

134.07317 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.080446 123.2
[M+Na]+ 157.062388 133.1
[M-H]- 133.065894 130.0
[M+NH4]+ 152.106993 139.8
[M+K]+ 173.036328 130.2
[M+H-H2O]+ 117.070430 117.4
[M+HCOO]- 179.071371 147.2
[M+CH3COO]- 193.087021 174.1
[M+Na-2H]- 155.047836 131.1
[M]+ 134.07262142 124.3
[M]- 134.07371858 124.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe