CID 28996

Acetamide, n-(9,10-dihydro-2-phenanthryl)-

Structural Information

Molecular Formula
C16H15NO
SMILES
CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3CC2
InChI
InChI=1S/C16H15NO/c1-11(18)17-14-8-9-16-13(10-14)7-6-12-4-2-3-5-15(12)16/h2-5,8-10H,6-7H2,1H3,(H,17,18)
InChIKey
OQLAAWHUAYKEBO-UHFFFAOYSA-N
Compound name
N-(9,10-dihydrophenanthren-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

2
Patents

237.11537 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.122646 151.4
[M+Na]+ 260.104588 158.5
[M-H]- 236.108094 156.5
[M+NH4]+ 255.149193 170.8
[M+K]+ 276.078528 154.0
[M+H-H2O]+ 220.112630 144.3
[M+HCOO]- 282.113571 172.2
[M+CH3COO]- 296.129221 163.5
[M+Na-2H]- 258.090036 159.0
[M]+ 237.11482142 149.8
[M]- 237.11591858 149.8
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