CID 601769

Phenanthrene, 9,10-dihydro-1-methyl-

Structural Information

Molecular Formula
C15H14
SMILES
CC1=C2CCC3=CC=CC=C3C2=CC=C1
InChI
InChI=1S/C15H14/c1-11-5-4-8-15-13(11)10-9-12-6-2-3-7-14(12)15/h2-8H,9-10H2,1H3
InChIKey
KACMLUGSVCDKQA-UHFFFAOYSA-N
Compound name
1-methyl-9,10-dihydrophenanthrene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.10954 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.116816 140.4
[M+Na]+ 217.098758 148.9
[M-H]- 193.102264 145.8
[M+NH4]+ 212.143363 162.2
[M+K]+ 233.072698 144.2
[M+H-H2O]+ 177.106800 133.9
[M+HCOO]- 239.107741 161.3
[M+CH3COO]- 253.123391 153.8
[M+Na-2H]- 215.084206 149.4
[M]+ 194.10899142 139.1
[M]- 194.11008858 139.1
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

No patent data available for this compound.