CID 136767

949-41-7

Structural Information

Molecular Formula
C15H12
SMILES
C1C2C1C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C15H12/c1-3-7-12-10(5-1)11-6-2-4-8-13(11)15-9-14(12)15/h1-8,14-15H,9H2
InChIKey
HJUMUYNFEXGVRH-UHFFFAOYSA-N
Compound name
1a,9b-dihydro-1H-cyclopropa[l]phenanthrene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

192.0939 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.101176 139.7
[M+Na]+ 215.083118 151.0
[M-H]- 191.086624 146.7
[M+NH4]+ 210.127723 157.6
[M+K]+ 231.057058 145.6
[M+H-H2O]+ 175.091160 132.9
[M+HCOO]- 237.092101 160.4
[M+CH3COO]- 251.107751 153.2
[M+Na-2H]- 213.068566 150.1
[M]+ 192.09335142 141.8
[M]- 192.09444858 141.8
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